Geometry & MOs

Info

ID:	293832
PubChem CID:	117404275
Reduced:	OSN2F3H7C10 (1)
Stoich.:	ABC2D3E7F10 (1)
Weight, g/mol:	260.086015
ΔH_f, kcal/mol:	-88.86
Dipole, Da:	3.19
IP(EA), eV:	-8.85(-1.34)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

methyl 2-[3-fluoro-5-(1-fluoroethyl)-2-methoxyphenyl]-2-hydroxyacetate

Drug info:

PubChemData

Smile

CSC1=C(C=C(C(=C1F)F)C2=NOC(=C2)N)F

DOS

IR

Vibrations